RDKit 3D 102105 0 0 0 0 0 0 0 0999 V2000 4.2335 2.9634 3.6193 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1081 1.9387 3.4602 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3821 1.0929 2.2907 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4165 1.2957 1.6027 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5187 0.0609 1.9177 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8654 -0.6910 0.7779 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4343 -1.9996 1.3603 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9737 -2.2391 2.7707 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9416 -3.0435 0.3846 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4994 -2.4847 0.2071 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9126 -2.6287 1.4215 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9417 -3.1843 -0.9293 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4526 -4.2014 -1.3396 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3206 -2.7130 -1.7043 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1957 -2.0955 -2.9369 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8981 -3.9669 -1.9365 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -4.4070 -2.6588 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -5.8531 -2.7059 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5828 -3.6363 -3.3564 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1234 -1.9468 -0.7484 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5840 -2.0708 -1.0160 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4146 -1.6789 0.1739 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5093 -1.4619 1.3259 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5229 -0.3645 1.0121 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7397 -0.2717 2.1676 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8353 0.7640 3.0849 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0172 0.7624 4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6801 1.6649 2.8256 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7659 -0.5692 -0.3148 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5608 0.4350 -1.2022 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6556 1.6832 -0.4585 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3497 2.7343 -1.0397 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8185 2.5455 -2.1974 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 4.0051 -0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2864 4.4263 0.3596 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9741 5.1002 -1.3461 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6093 -0.1698 -0.0685 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8582 0.8916 -1.0672 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2372 2.1548 -0.7958 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3908 2.4972 0.3761 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4863 3.1737 -1.8589 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1967 2.5687 -3.0393 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2146 4.3328 -1.2704 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3954 5.4652 -2.2534 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7728 -1.0821 -0.1510 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4791 -3.0496 -0.3712 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8068 -3.3639 -1.0375 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0094 -4.1367 0.5516 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8806 3.6883 4.3744 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1524 2.4955 4.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4115 3.4749 2.6491 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1871 2.5521 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0171 1.3676 4.4013 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7796 -0.2675 0.2776 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5319 -2.0343 1.3248 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8234 -2.0314 3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1543 -1.5650 3.0794 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6508 -3.2864 2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8819 -4.0463 0.8064 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4775 -2.9463 -0.5632 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6439 -3.5252 1.6752 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4717 -2.2319 -3.8253 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2089 -2.5520 -3.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4333 -1.0188 -2.8845 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5081 -6.5367 -2.5966 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8731 -6.0802 -3.6419 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1055 -5.9807 -1.8885 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9892 -2.5500 0.2317 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9989 -1.5849 -1.9487 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2673 -0.9683 0.0456 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0977 -2.3413 1.8211 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1742 -1.0060 2.1372 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1437 0.5660 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4892 0.3195 5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9312 0.1778 4.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3022 1.7931 4.5573 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1028 0.6591 -2.1338 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5922 0.1341 -1.3054 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3408 3.9089 0.4362 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 3.5707 0.9841 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4614 5.3424 0.9914 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5393 4.6218 -0.4241 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1255 5.1848 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8894 4.7660 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 6.0344 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7243 0.3750 0.8677 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4897 3.5325 -2.2455 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 1.9099 -3.5776 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4393 3.3810 -3.7812 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 1.9811 -2.7817 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7849 4.7090 -0.3314 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2823 4.0347 -0.9972 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8409 6.3338 -1.7424 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0648 5.1923 -3.0917 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4244 5.7957 -2.6815 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -1.0166 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5647 -3.4592 -0.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7637 -4.2593 -1.6623 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1672 -2.5330 -1.6638 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4079 -3.8868 1.5789 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4903 -5.1283 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9386 -4.3123 0.5808 H 0 0 0 0 0 0 0 0 0 0 0 0 44 43 1 0 43 41 1 0 41 42 1 0 41 39 1 0 39 40 2 0 39 38 1 0 38 37 1 0 37 45 1 0 45 6 1 0 6 5 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 1 10 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 14 16 1 6 16 17 1 0 17 18 1 0 17 19 2 0 14 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 26 28 2 0 24 29 1 0 29 30 1 6 30 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0 34 35 1 0 34 36 1 0 22 46 1 0 46 47 1 0 46 48 1 0 29 37 1 0 10 45 1 0 29 20 1 0 46 21 1 0 44 93 1 0 44 94 1 0 44 95 1 0 43 91 1 0 43 92 1 0 41 87 1 6 42 88 1 0 42 89 1 0 42 90 1 0 37 86 1 1 45 96 1 6 6 54 1 6 2 52 1 0 2 53 1 0 1 49 1 0 1 50 1 0 1 51 1 0 7 55 1 1 8 56 1 0 8 57 1 0 8 58 1 0 9 59 1 0 9 60 1 0 11 61 1 0 15 62 1 0 15 63 1 0 15 64 1 0 18 65 1 0 18 66 1 0 18 67 1 0 20 68 1 1 21 69 1 6 22 70 1 6 23 71 1 0 23 72 1 0 24 73 1 6 27 74 1 0 27 75 1 0 27 76 1 0 30 77 1 0 30 78 1 0 34 79 1 0 35 80 1 0 35 81 1 0 35 82 1 0 36 83 1 0 36 84 1 0 36 85 1 0 47 97 1 0 47 98 1 0 47 99 1 0 48100 1 0 48101 1 0 48102 1 0 M END